methyl (2R,3S,5S,6S)-6-ethyl-3,5-dimethyl-1-(phenylmethyl)piperidine-2-carboxylate

Systemtic Name: methyl (2R,3S,5S,6S)-6-ethyl-3,5-dimethyl-1-(phenylmethyl)piperidine-2-carboxylate Openeye Name: methyl (2R,3S,5S,6S)-1-benzyl-6-ethyl-3,5-dimethyl-piperidine-2-carboxylate CAS Name: (2R,3S,5S,6S)-6-ethyl-3,5-dimethyl-1-(phenylmethyl)-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,3S,5S,6S)-1-benzyl-6-ethyl-3,5-dimethylpiperidine-2-carboxylate Traditional Name: (2R,3S,5S,6S)-1-benzyl-6-ethyl-3,5-dimethyl-pipecolinic acid methyl ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CC(C(N1CC2=CC=CC=C2)C(=O)OC)C)C

Isomeric SMILES

CC[C@H]1[C@H](C[C@@H]([C@@H](N1CC2=CC=CC=C2)C(=O)OC)C)C

InChI

InChI=1S/C18H27NO2/c1-5-16-13(2)11-14(3)17(18(20)21-4)19(16)12-15-9-7-6-8-10-15/h6-10,13-14,16-17H,5,11-12H2,1-4H3/t13-,14-,16-,17+/m0/s1